N-cyclopropyl-4-methyl-3-[7-[3-[methyl(oxolan-2-ylmethyl)amino]propoxy]-1-oxidanylidene-isoquinolin-2-yl]benzamide

Systemtic Name: N-cyclopropyl-4-methyl-3-[7-[3-[methyl(oxolan-2-ylmethyl)amino]propoxy]-1-oxidanylidene-isoquinolin-2-yl]benzamide Openeye Name: N-cyclopropyl-4-methyl-3-[7-[3-[methyl(tetrahydrofuran-2-ylmethyl)amino]propoxy]-1-oxo-2-isoquinolyl]benzamide CAS Name: N-cyclopropyl-4-methyl-3-[7-[3-[methyl(2-oxolanylmethyl)amino]propoxy]-1-oxo-2-isoquinolinyl]benzamide IUPAC Name: N-cyclopropyl-4-methyl-3-[7-[3-[methyl(oxolan-2-ylmethyl)amino]propoxy]-1-oxoisoquinolin-2-yl]benzamide Traditional Name: N-cyclopropyl-3-[1-keto-7-[3-[methyl(tetrahydrofurfuryl)amino]propoxy]-2-isoquinolyl]-4-methyl-benzamide Formula: C29H35N3O4 MolecularWeight: 489.6059

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NC2CC2)N3C=CC4=C(C3=O)C=C(C=C4)OCCCN(C)CC5CCCO5

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NC2CC2)N3C=CC4=C(C3=O)C=C(C=C4)OCCCN(C)CC5CCCO5

InChI

InChI=1S/C29H35N3O4/c1-20-6-7-22(28(33)30-23-9-10-23)17-27(20)32-14-12-21-8-11-24(18-26(21)29(32)34)35-16-4-13-31(2)19-25-5-3-15-36-25/h6-8,11-12,14,17-18,23,25H,3-5,9-10,13,15-16,19H2,1-2H3,(H,30,33)